(4-azanyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)methyl 4-oxidanylidene-4-thiophen-2-yl-butanoate

Systemtic Name: (4-azanyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)methyl 4-oxidanylidene-4-thiophen-2-yl-butanoate Openeye Name: (4-amino-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)methyl 4-oxo-4-(2-thienyl)butanoate CAS Name: 4-oxo-4-thiophen-2-ylbutanoic acid (4-amino-5,6-dimethyl-2-thieno[2,3-d]pyrimidinyl)methyl ester IUPAC Name: (4-amino-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl)methyl 4-oxo-4-thiophen-2-ylbutanoate Traditional Name: 4-keto-4-(2-thienyl)butyric acid (4-amino-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)methyl ester Formula: C17H17N3O3S2 MolecularWeight: 375.46518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N)COC(=O)CCC(=O)C3=CC=CS3)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N)COC(=O)CCC(=O)C3=CC=CS3)C

InChI

InChI=1S/C17H17N3O3S2/c1-9-10(2)25-17-15(9)16(18)19-13(20-17)8-23-14(22)6-5-11(21)12-4-3-7-24-12/h3-4,7H,5-6,8H2,1-2H3,(H2,18,19,20)